ChemSpider 2D Image | N-[cis-3-(2-Amino-6-oxo-1,6-dihydro-4-pyrimidinyl)cyclobutyl]-3-fluoroisonicotinamide | C14H14FN5O2

N-[cis-3-(2-Amino-6-oxo-1,6-dihydro-4-pyrimidinyl)cyclobutyl]-3-fluoroisonicotinamide

  • Molecular FormulaC14H14FN5O2
  • Average mass303.292 Da
  • Monoisotopic mass303.113159 Da
  • ChemSpider ID35070221

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4-Pyridinecarboxamide, N-[cis-3-(2-amino-1,6-dihydro-6-oxo-4-pyrimidinyl)cyclobutyl]-3-fluoro- [ACD/Index Name]
N-[cis-3-(2-Amino-6-oxo-1,6-dihydro-4-pyrimidinyl)cyclobutyl]-3-fluorisonicotinamid [German] [ACD/IUPAC Name]
N-[cis-3-(2-Amino-6-oxo-1,6-dihydro-4-pyrimidinyl)cyclobutyl]-3-fluoroisonicotinamide [ACD/IUPAC Name]
N-[cis-3-(2-Amino-6-oxo-1,6-dihydro-4-pyrimidinyl)cyclobutyl]-3-fluoroisonicotinamide [French] [ACD/IUPAC Name]
N-[cis-3-(2-amino-6-oxo-1,6-dihydropyrimidin-4-yl)cyclobutyl]-3-fluoroisonicotinamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.744
Molar Refractivity: 75.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.10
ACD/LogD (pH 5.5): -0.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.70
ACD/LogD (pH 7.4): -0.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 12.70
Polar Surface Area: 109 Å2
Polarizability: 29.8±0.5 10-24cm3
Surface Tension: 65.7±7.0 dyne/cm
Molar Volume: 185.6±7.0 cm3

Click to predict properties on the Chemicalize site


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